Propiconazole-4H-1,2,4-triazole

Details

Stereochemistry	MIXED
Molecular Formula	C15H17Cl2N3O2
Molecular Weight	342.22
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Propiconazole-4H-1,2,4-triazole

SMILES

CCCC1COC(CN2C=NN=C2)(O1)C3=CC=C(Cl)C=C3Cl

InChI

InChIKey=NZEKXQPHAKNDLR-UHFFFAOYSA-N

InChI=1S/C15H17Cl2N3O2/c1-2-3-12-7-21-15(22-12,8-20-9-18-19-10-20)13-5-4-11(16)6-14(13)17/h4-6,9-10,12H,2-3,7-8H2,1H3

HIDE SMILES / InChI

Molecular Formula	C15H17Cl2N3O2
Molecular Weight	342.22
Charge	0
Count	MOL RATIO 1 MOL RATIO (average)

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical
Record UNII	C7G6MR7ALK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-[[2-(2,4-Dichlorophenyl)-4-propyl-1,3-dioxolan-2-yl]methyl]-4H-1,2,4-triazole

Preferred Name

English

Propiconazole-4H-1,2,4-triazole

Common Name

English

Propiconazole-4H-1,2,4-triazole (Mixture of Diastereomers)

Systematic Name

English

4H-1,2,4-Triazole, 4-[[2-(2,4-dichlorophenyl)-4-propyl-1,3-dioxolan-2-yl]methyl]-

Systematic Name

English

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Code System

Code

Type

Description

FDA UNII

C7G6MR7ALK

PRIMARY

PUBCHEM

60132952

PRIMARY

EPA CompTox

DTXSID60733660

PRIMARY

CAS

221132-58-7

PRIMARY

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